methyl 5-[[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]methyl]furan-2-carboxylate Openeye Name: methyl 5-[(4-benzhydrylpiperazine-1,4-diium-1-yl)methyl]furan-2-carboxylate CAS Name: 5-[[4-(diphenylmethyl)-1-piperazine-1,4-diiumyl]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-benzhydrylpiperazine-1,4-diium-1-yl)methyl]furan-2-carboxylate Traditional Name: 5-[(4-benzhydrylpiperazine-1,4-diium-1-yl)methyl]furan-2-carboxylic acid methyl ester Formula: C24H28N2O3+2 MolecularWeight: 392.49072

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)C[NH+]2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(O1)C[NH+]2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H26N2O3/c1-28-24(27)22-13-12-21(29-22)18-25-14-16-26(17-15-25)23(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-13,23H,14-18H2,1H3/p+2